Chem
J-GLOBAL ID：200907095378734739   Nikkaji number：J600.723F

3,5-Bis[4-(methylthio)benzylidene]piperidin-4-one

3,5-ビス[4-(メチルチオ)ベンジリデン]ピペリジン-4-オン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H21NOS2
Molecular formula furigana： C21-H21-N-O-S2
Molecular weight： 367.530
InChI： InChI=1S/C21H21NOS2/c1-24-19-7-3-15(4-8-19)11-17-13-22-14-18(21(17)23)12-16-5-9-20(25-2)10-6-16/h3-12,22H,13-14H2,1-2H3
InChI key： YFMYNOUCTKNNOG-UHFFFAOYSA-N
SMILES： CSc1ccc(C=C2CNCC(=Cc3ccc(SC)cc3)C2=O)cc1
Systematic name  (3)：
  • 3,5-ビス[4-(メチルチオ)ベンジリデン]ピペリジン-4-オン
  • 3,5-ビス({[4-(メチルスルファニル)フェニル]メチリデン})ピペリジン-4-オン
  • 3,5-bis({[4-(methylsulfanyl)phenyl]methylidene})piperidin-4-one
Other name (1)：
  • 3,5-Bis[4-(methylthio)benzylidene]piperidin-4-one
Thsaurus map：
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